Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TNKS | O95271 | 7/20 | 0.50 |
| ▸ | TNKS2 | Q9H2K2 | 7/20 | 0.50 |
| ▸ | PARP1 | P09874 | 4/20 | 0.50 |
| ▸ | PARP2 | Q9UGN5 | 3/20 | 0.45 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.42 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.42 |
| ▸ | WNT3A | P56704 | 1/20 | 0.41 |
| ▸ | NPY5R | Q15761 | 1/20 | 0.41 |
| ▸ | PIM1 | P11309 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.40 |
| ▸ | KIT | P10721 | 2/20 | 0.38 |
| ▸ | COMT | P21964 | 1/20 | 0.38 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.38 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.38 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL30101887 | 0.81 | PIM1 (0.39) | TNKSTNKS2PARP1PARP2DGAT1 | |
| SCHEMBL30101920 | 0.79 | PIM1 (0.38) | TNKSTNKS2PARP1PARP2DGAT1 | |
| SCHEMBL30101909 | 0.79 | AHR (0.39) | TNKSTNKS2PARP1PARP2DGAT1 | |
| SCHEMBL31472805 | 0.78 | PIM1 (0.39) | TNKSTNKS2PARP2DGAT1KCNH2 | |
| SCHEMBL30101858 | 0.78 | AHR (0.38) | TNKSTNKS2PARP1PARP2DGAT1 | |
| SCHEMBL30101960 | 0.78 | PIM1 (0.37) | TNKSTNKS2PARP1DGAT1KCNH2 | |
| SCHEMBL31472804 | 0.78 | PIM1 (0.37) | TNKSTNKS2PARP1PARP2DGAT1 | |
| SCHEMBL30101867 | 0.78 | PIM1 (0.37) | TNKSTNKS2PARP1DGAT1KCNH2 | |
| SCHEMBL23950529 | 0.78 | PIM1 (0.45) | PARP1DGAT1KCNH2NPY5RPIM1 | |
| SCHEMBL30101918 | 0.78 | PIM1 (0.45) | PARP1DGAT1KCNH2NPY5RPIM1 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115443276-A | Pyridopyrimidinone derivatives and their use as modulators of aromatic hydrocarbon receptors | 东亚ST株式会社 | 2022-12-06 | — | — | CN | claimed |
| CN-115443276-A | Pyridopyrimidinone derivatives and their use as modulators of aromatic hydrocarbon receptors | 东亚ST株式会社 | 2022-12-06 | — | — | CN | disclosed |